Substrate
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Generation 1
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Generation 2
XenoSite
Bambuterol
CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(C(O)CNC(C)(C)C)c1
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 1
Show metabolites
Dimethylformamide
CN(C)C=O
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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stable oxygenation
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unstable oxygenation
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dehydrogenation
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reduction
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hydrolysis
Generation 2
Show metabolites
Methylformamide
CNC=O
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 3
Select a metabolite to form the next generation.
n dealkylation
Probability 0.42
0.42
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Formaldehyde
n dealkylation
Probability 0.42
0.42
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Methanol
n dealkylation
Probability 0.42
0.42
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Formamide
n dealkylation
Probability 0.42
0.42
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Formic acid
n dealkylation
Probability 0.02
0.02
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Methylamine
Showing 5 of 7 metabolites
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